3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide

C14H20N2O2 — CID 82829222

IUPAC3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide
SMILESCc1c(O)cccc1C(=O)NCC1CCNCC1
InChIInChI=1S/C14H20N2O2/c1-10-12(3-2-4-13(10)17)14(18)16-9-11-5-7-15-8-6-11/h2-4,11,15,17H,5-9H2,1H3,(H,16,18)
InChIKeyRXCCYXOUGPUNDA-UHFFFAOYSA-N
MW248.33 g/mol
LogP1.43
Rot. Bonds3

About 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide

3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide (PubChem CID 82829222) has the molecular formula C14H20N2O2 and a molecular weight of 248.33 g/mol. Its IUPAC name is 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide.

Molecular Properties

Compound Name3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide
PubChem CID82829222
Molecular FormulaC14H20N2O2
Molecular Weight248.33 g/mol
Exact Mass248.15
IUPAC Name3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide
SMILESCc1c(O)cccc1C(=O)NCC1CCNCC1
InChIInChI=1S/C14H20N2O2/c1-10-12(3-2-4-13(10)17)14(18)16-9-11-5-7-15-8-6-11/h2-4,11,15,17H,5-9H2,1H3,(H,16,18)
InChIKeyRXCCYXOUGPUNDA-UHFFFAOYSA-N
XLogP1.43
TPSA61.36 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.33
LogP ≤ 51.43
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclohexylmethyl)-3-hydroxy-2-methylbenzamide
CID 82826551
N-(cyclopropylmethyl)-2-methyl-3-piperidin-4-ylbenzamide
CID 171362054
N-[(3-aminocyclohexyl)methyl]-3-hydroxy-2-methylbenzamide
CID 106123416
3-hydroxy-N-[(2-hydroxycyclohexyl)methyl]-2-methylbenzamide
CID 82828909
N-[(4-hydroxycyclohexyl)methyl]-2,3-dimethylbenzamide
CID 106123854
4-hydroxy-3-methyl-N-(piperidin-4-ylmethyl)benzamide
CID 107671970
4-methoxy-2,3-dimethyl-N-(pyrrolidin-3-ylmethyl)benzamide
CID 115271837
2-methyl-N-(pyrrolidin-3-ylmethyl)pyridine-3-carboxamide
CID 80564265
4-methyl-N-(piperidin-4-ylmethyl)thiophene-3-carboxamide
CID 79808514
2,5-dimethyl-N-(piperidin-4-ylmethyl)furan-3-carboxamide
CID 60725294
N-[[2-(aminomethyl)cyclopentyl]methyl]-3-hydroxy-2-methylbenzamide
CID 82830986
N-[(1,4-dimethylpiperazin-2-yl)methyl]-3-hydroxy-2-methylbenzamide
CID 82829349

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
The IUPAC name of 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide (CID 82829222) is 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide.
What is the SMILES notation for 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
The canonical SMILES for 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide is Cc1c(O)cccc1C(=O)NCC1CCNCC1.
What is the InChIKey of 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
The InChIKey is RXCCYXOUGPUNDA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O2/c1-10-12(3-2-4-13(10)17)14(18)16-9-11-5-7-15-8-6-11/h2-4,11,15,17H,5-9H2,1H3,(H,16,18).
What are the key properties of 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide?
3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide has a molecular weight of 248.33 g/mol, XLogP of 1.43, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-2-methyl-N-(piperidin-4-ylmethyl)benzamide is sourced from PubChem (CID 82829222), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).